N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine

C14H23N3O — CID 113371376

IUPACN-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
SMILESCCCOc1cccnc1NCC1CCCC1N
InChIInChI=1S/C14H23N3O/c1-2-9-18-13-7-4-8-16-14(13)17-10-11-5-3-6-12(11)15/h4,7-8,11-12H,2-3,5-6,9-10,15H2,1H3,(H,16,17)
InChIKeyXRLJHVAFDVRGQG-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.41
Rot. Bonds6

About N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine

N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine (PubChem CID 113371376) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine.

Molecular Properties

Compound NameN-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
PubChem CID113371376
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
SMILESCCCOc1cccnc1NCC1CCCC1N
InChIInChI=1S/C14H23N3O/c1-2-9-18-13-7-4-8-16-14(13)17-10-11-5-3-6-12(11)15/h4,7-8,11-12H,2-3,5-6,9-10,15H2,1H3,(H,16,17)
InChIKeyXRLJHVAFDVRGQG-UHFFFAOYSA-N
XLogP2.41
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-chlorocyclohexyl)methyl]-3-ethoxypyridin-2-amine
CID 113371327
N-(morpholin-2-ylmethyl)-3-propoxypyridin-2-amine
CID 113371141
N-[[1-(dimethylamino)cyclobutyl]methyl]-3-propoxypyridin-2-amine
CID 105419140
N-[(4-ethylphenyl)methyl]-3-propoxypyridin-2-amine
CID 106900046
N-(2-methyl-2-methylsulfanylpropyl)-3-propoxypyridin-2-amine
CID 113479021
2,2-dimethyl-N-(3-propoxy-2-pyridinyl)pentane-1,5-diamine
CID 106142911
N-[(2-aminocyclopentyl)methyl]-4-ethoxypyrimidin-2-amine
CID 112639496
4,4-dimethyl-1-N-(3-propoxy-2-pyridinyl)pentane-1,2-diamine
CID 107159121
N-pent-4-ynyl-3-propoxypyridin-2-amine
CID 106222583
4-[[(3-propoxy-2-pyridinyl)amino]methyl]phenol
CID 114332578
N-pent-3-ynyl-3-propoxypyridin-2-amine
CID 116644405
N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 106128059

Frequently Asked Questions

What is the IUPAC name of N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine?
The IUPAC name of N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine (CID 113371376) is N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine.
What is the SMILES notation for N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine?
The canonical SMILES for N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine is CCCOc1cccnc1NCC1CCCC1N.
What is the InChIKey of N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine?
The InChIKey is XRLJHVAFDVRGQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-2-9-18-13-7-4-8-16-14(13)17-10-11-5-3-6-12(11)15/h4,7-8,11-12H,2-3,5-6,9-10,15H2,1H3,(H,16,17).
What are the key properties of N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine?
N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine has a molecular weight of 249.36 g/mol, XLogP of 2.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine is sourced from PubChem (CID 113371376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).