1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine

C23H29N3O — CID 57242406

IUPAC1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine
SMILESCCCN(CCOc1cccc2ccccc12)CC(C)Nc1ccccn1
InChIInChI=1S/C23H29N3O/c1-3-15-26(18-19(2)25-23-13-6-7-14-24-23)16-17-27-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,24,25)
InChIKeyFFBQSPKGUHQVRO-UHFFFAOYSA-N
MW363.50 g/mol
LogP4.83
Rot. Bonds10

About 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine

1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine (PubChem CID 57242406) has the molecular formula C23H29N3O and a molecular weight of 363.50 g/mol. Its IUPAC name is 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine
PubChem CID57242406
Molecular FormulaC23H29N3O
Molecular Weight363.50 g/mol
Exact Mass363.23
IUPAC Name1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine
SMILESCCCN(CCOc1cccc2ccccc12)CC(C)Nc1ccccn1
InChIInChI=1S/C23H29N3O/c1-3-15-26(18-19(2)25-23-13-6-7-14-24-23)16-17-27-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,24,25)
InChIKeyFFBQSPKGUHQVRO-UHFFFAOYSA-N
XLogP4.83
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.50
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine with MolForge

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Related Compounds

2-[5-[2-[bis(pyridin-2-ylmethyl)amino]ethoxy]naphthalen-1-yl]oxy-N,N-bis(pyridin-2-ylmethyl)ethanamine
CID 102131469
1-butoxynaphthalene
CID 13262700
(4R)-1-N,1-N-diethyl-4-N-pyridin-2-ylpentane-1,4-diamine
CID 40545835
5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine
CID 63505261
N-(2-chloroethyl)-N-ethyl-2-naphthalen-1-yloxyethanamine;hydrochloride
CID 24847300
1-(4-methylpentoxy)naphthalene
CID 83168126
N-[2-(diethylamino)ethoxy]pyridin-2-amine
CID 54382786
(1S)-N-(2-naphthalen-1-yloxyethyl)-1-phenylethanamine
CID 2183529
N-butyl-4-naphthalen-1-yloxybutan-1-amine
CID 2249724
3-naphthalen-1-yloxy-N-[(1S)-1-phenylethyl]propan-1-amine
CID 2183626
N-(6-methylheptan-2-yl)pyridin-2-amine
CID 61472531
N',N'-dimethyl-N-(3-naphthalen-1-yloxypropyl)propane-1,3-diamine
CID 2182334

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine?
The IUPAC name of 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine (CID 57242406) is 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine is CCCN(CCOc1cccc2ccccc12)CC(C)Nc1ccccn1.
What is the InChIKey of 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine?
The InChIKey is FFBQSPKGUHQVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O/c1-3-15-26(18-19(2)25-23-13-6-7-14-24-23)16-17-27-22-12-8-10-20-9-4-5-11-21(20)22/h4-14,19H,3,15-18H2,1-2H3,(H,24,25).
What are the key properties of 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine?
1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine has a molecular weight of 363.50 g/mol, XLogP of 4.83, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-naphthalen-1-yloxyethyl)-1-N-propyl-2-N-pyridin-2-ylpropane-1,2-diamine is sourced from PubChem (CID 57242406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).