3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine

C16H26N4 — CID 62976010

IUPAC3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine
SMILESCN(CCc1ccncc1)C1(CN)CCN(C2CC2)C1
InChIInChI=1S/C16H26N4/c1-19(10-6-14-4-8-18-9-5-14)16(12-17)7-11-20(13-16)15-2-3-15/h4-5,8-9,15H,2-3,6-7,10-13,17H2,1H3
InChIKeyHUQGQYRIZHFLPP-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.12
Rot. Bonds6

About 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine

3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine (PubChem CID 62976010) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine
PubChem CID62976010
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine
SMILESCN(CCc1ccncc1)C1(CN)CCN(C2CC2)C1
InChIInChI=1S/C16H26N4/c1-19(10-6-14-4-8-18-9-5-14)16(12-17)7-11-20(13-16)15-2-3-15/h4-5,8-9,15H,2-3,6-7,10-13,17H2,1H3
InChIKeyHUQGQYRIZHFLPP-UHFFFAOYSA-N
XLogP1.12
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine
CID 54945376
3-(aminomethyl)-N-methyl-1,1-dioxo-N-(2-pyridin-4-ylethyl)thiolan-3-amine
CID 63162824
3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine
CID 62975820
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)pyrrolidin-3-amine
CID 62977877
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
CID 62977319
3-(aminomethyl)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopropyl-N-methylpyrrolidin-3-amine
CID 62980197
1-N-methyl-1-N-(2-pyridin-4-ylethyl)cyclopentane-1,2-diamine
CID 60912856
1-(aminomethyl)-N-methyl-N-(2-phenylethyl)cyclobutan-1-amine
CID 79521880
3-(aminomethyl)-N-butyl-1-cyclopropyl-N-ethylpyrrolidin-3-amine
CID 62975638
1-(aminomethyl)-N-propyl-N-(2-pyridin-4-ylethyl)cycloheptan-1-amine
CID 62008128
3-(aminomethyl)-N-methyl-1-propan-2-yl-N-(2-thiophen-2-ylethyl)pyrrolidin-3-amine
CID 79476289
1-(aminomethyl)-N,3-dimethyl-N-(pyridin-4-ylmethyl)cyclohexan-1-amine
CID 43564069

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine?
The IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine (CID 62976010) is 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine.
What is the SMILES notation for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine?
The canonical SMILES for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine is CN(CCc1ccncc1)C1(CN)CCN(C2CC2)C1.
What is the InChIKey of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine?
The InChIKey is HUQGQYRIZHFLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-19(10-6-14-4-8-18-9-5-14)16(12-17)7-11-20(13-16)15-2-3-15/h4-5,8-9,15H,2-3,6-7,10-13,17H2,1H3.
What are the key properties of 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine?
3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine has a molecular weight of 274.41 g/mol, XLogP of 1.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-1-cyclopropyl-N-methyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 62976010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).