2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide

C14H29N3O2 — CID 107471024

IUPAC2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide
SMILESCC(C)(C)CC(CN)C(=O)NCCN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1-14(2,3)10-12(11-15)13(18)16-4-5-17-6-8-19-9-7-17/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyWJQPWPVYQQIBNB-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.45
Rot. Bonds6

About 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide

2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide (PubChem CID 107471024) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide
PubChem CID107471024
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide
SMILESCC(C)(C)CC(CN)C(=O)NCCN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1-14(2,3)10-12(11-15)13(18)16-4-5-17-6-8-19-9-7-17/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyWJQPWPVYQQIBNB-UHFFFAOYSA-N
XLogP0.45
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-4,4-dimethyl-N-(2-methyl-2-morpholin-4-ylpropyl)pentanamide
CID 107471820
(2R)-2-amino-3,3-dimethyl-N-(2-morpholin-4-ylethyl)butanamide
CID 83300699
2-(aminomethyl)-4,4-dimethyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)pentanamide
CID 107472675
2-amino-N-(2-morpholin-4-ylethyl)propanamide;dihydrochloride
CID 119827782
(2S)-2,6-diamino-N-(2-morpholin-4-ylethyl)hexanamide
CID 131845980
2-amino-3-ethyl-N-(2-morpholin-4-ylethyl)pentanamide
CID 67174978
4-N-tert-butyl-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045886
(2S)-2-amino-3,3-dimethyl-N-(4-morpholin-4-ylbutyl)butanamide;dihydrochloride
CID 119852486
3-[[2-(aminomethyl)-4,4-dimethylpentanoyl]amino]propanoic acid
CID 107471719
(2S)-2,3-dichloro-2-methyl-N-(2-morpholin-4-ylethyl)propanamide
CID 7375443
2-(aminomethyl)-4,4-dimethyl-N-[(3-methyloxetan-3-yl)methyl]pentanamide
CID 107472428
(2R)-2,4-dihydroxy-3,3-dimethyl-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]butanamide
CID 25171579

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide?
The IUPAC name of 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide (CID 107471024) is 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide.
What is the SMILES notation for 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide?
The canonical SMILES for 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide is CC(C)(C)CC(CN)C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide?
The InChIKey is WJQPWPVYQQIBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-14(2,3)10-12(11-15)13(18)16-4-5-17-6-8-19-9-7-17/h12H,4-11,15H2,1-3H3,(H,16,18).
What are the key properties of 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide?
2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide has a molecular weight of 271.40 g/mol, XLogP of 0.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4,4-dimethyl-N-(2-morpholin-4-ylethyl)pentanamide is sourced from PubChem (CID 107471024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).