3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide

C24H31N3O3 — CID 55519412

IUPAC3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide
SMILESCC(C)C(CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)N1CCOCC1
InChIInChI=1S/C24H31N3O3/c1-16(2)22(27-9-11-30-12-10-27)15-25-24(29)20-13-18-5-3-4-6-19(18)14-21(20)26-23(28)17-7-8-17/h3-6,13-14,16-17,22H,7-12,15H2,1-2H3,(H,25,29)(H,26,28)
InChIKeyHBAJUJWIAHVHAG-UHFFFAOYSA-N
MW409.53 g/mol
LogP3.27
Rot. Bonds7

About 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide

3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide (PubChem CID 55519412) has the molecular formula C24H31N3O3 and a molecular weight of 409.53 g/mol. Its IUPAC name is 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide
PubChem CID55519412
Molecular FormulaC24H31N3O3
Molecular Weight409.53 g/mol
Exact Mass409.24
IUPAC Name3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide
SMILESCC(C)C(CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)N1CCOCC1
InChIInChI=1S/C24H31N3O3/c1-16(2)22(27-9-11-30-12-10-27)15-25-24(29)20-13-18-5-3-4-6-19(18)14-21(20)26-23(28)17-7-8-17/h3-6,13-14,16-17,22H,7-12,15H2,1-2H3,(H,25,29)(H,26,28)
InChIKeyHBAJUJWIAHVHAG-UHFFFAOYSA-N
XLogP3.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopropanecarbonylamino)-N-(2-hydroxypropyl)naphthalene-2-carboxamide
CID 110886656
N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide
CID 25497917
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
N-(3-methyl-2-morpholin-4-ylbutyl)-2-morpholin-4-ylquinoline-4-carboxamide
CID 46975815
3-(cyclopropanecarbonylamino)-N-(2-methyl-2-piperidin-1-ylpropyl)naphthalene-2-carboxamide
CID 47012254
3-(cyclopropanecarbonylamino)-N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]naphthalene-2-carboxamide
CID 30889082
N-(3-methyl-2-morpholin-4-ylbutyl)pyrrolidine-3-carboxamide
CID 119841324
N-(3-methyl-2-morpholin-4-ylbutyl)-2-(thiophene-2-carbonyl)benzamide
CID 55518986
N-(3-methyl-2-morpholin-4-ylbutyl)-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 134055842
3-(cyclopropanecarbonylamino)-N-[2-(methanesulfonamido)-2-oxoethyl]naphthalene-2-carboxamide
CID 166393096
5-cyclopropyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-1,2-oxazole-3-carboxamide
CID 95129634
2-methyl-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-morpholin-4-ylbenzamide
CID 92626787

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide?
The IUPAC name of 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide (CID 55519412) is 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide.
What is the SMILES notation for 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide?
The canonical SMILES for 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide is CC(C)C(CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)N1CCOCC1.
What is the InChIKey of 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide?
The InChIKey is HBAJUJWIAHVHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O3/c1-16(2)22(27-9-11-30-12-10-27)15-25-24(29)20-13-18-5-3-4-6-19(18)14-21(20)26-23(28)17-7-8-17/h3-6,13-14,16-17,22H,7-12,15H2,1-2H3,(H,25,29)(H,26,28).
What are the key properties of 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide?
3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide has a molecular weight of 409.53 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide is sourced from PubChem (CID 55519412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).