N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine

C13H21N3 — CID 62470751

IUPACN-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
SMILESCCCNc1ncccc1CN1CCCC1
InChIInChI=1S/C13H21N3/c1-2-7-14-13-12(6-5-8-15-13)11-16-9-3-4-10-16/h5-6,8H,2-4,7,9-11H2,1H3,(H,14,15)
InChIKeyFCSHDWRRABUPLV-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.50
Rot. Bonds5

About N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine

N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine (PubChem CID 62470751) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
PubChem CID62470751
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
SMILESCCCNc1ncccc1CN1CCCC1
InChIInChI=1S/C13H21N3/c1-2-7-14-13-12(6-5-8-15-13)11-16-9-3-4-10-16/h5-6,8H,2-4,7,9-11H2,1H3,(H,14,15)
InChIKeyFCSHDWRRABUPLV-UHFFFAOYSA-N
XLogP2.50
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-methyl-1,4-diazepan-1-yl)methyl]-N-propylpyridin-2-amine
CID 62470227
4-methyl-1-[[2-(propylamino)-3-pyridinyl]methyl]azepan-4-ol
CID 107408579
3-[(4-methylpiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62470200
3-[(4-propan-2-ylpiperazin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62469718
1-[4-[[2-(propylamino)-3-pyridinyl]methyl]piperazin-1-yl]ethanone
CID 62470561
3-[(3-methylpyrrolidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 55075699
3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 107394997
1-[[2-(propylamino)-3-pyridinyl]methyl]azepan-2-one
CID 55075717
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N-propylpyridin-2-amine
CID 63024773
1-[[2-(propylamino)-3-pyridinyl]methyl]piperidine-2,6-dione
CID 55075292
3-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]-N-propylpyridin-2-amine
CID 79164091
2-[1-[[2-(propylamino)-3-pyridinyl]methyl]pyrrolidin-3-yl]ethanol
CID 114799919

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine?
The IUPAC name of N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine (CID 62470751) is N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine.
What is the SMILES notation for N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine?
The canonical SMILES for N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine is CCCNc1ncccc1CN1CCCC1.
What is the InChIKey of N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine?
The InChIKey is FCSHDWRRABUPLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-2-7-14-13-12(6-5-8-15-13)11-16-9-3-4-10-16/h5-6,8H,2-4,7,9-11H2,1H3,(H,14,15).
What are the key properties of N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine?
N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 62470751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).