1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine

C14H29N3 — CID 43179038

IUPAC1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine
SMILESCCN1CCC(NCC2CCCN2CC)CC1
InChIInChI=1S/C14H29N3/c1-3-16-10-7-13(8-11-16)15-12-14-6-5-9-17(14)4-2/h13-15H,3-12H2,1-2H3
InChIKeyAGDCYDRBNLMGSA-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds5

About 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine

1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine (PubChem CID 43179038) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine
PubChem CID43179038
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine
SMILESCCN1CCC(NCC2CCCN2CC)CC1
InChIInChI=1S/C14H29N3/c1-3-16-10-7-13(8-11-16)15-12-14-6-5-9-17(14)4-2/h13-15H,3-12H2,1-2H3
InChIKeyAGDCYDRBNLMGSA-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethylpyrrolidin-2-yl)methyl]-1-methylazepan-4-amine
CID 65071094
N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]oxan-4-amine
CID 93218125
N-(cyclopentylmethyl)-1-ethylazepan-4-amine
CID 65074491
cis-(1R,3S)-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-3-methylcyclopentan-1-amine
CID 95376229
N-[(1-ethylpyrrolidin-2-yl)methyl]pyrrolidin-3-amine
CID 79725125
N-(cyclobutylmethyl)-1-ethylpiperidin-4-amine
CID 43298506
1-ethyl-N-(thian-4-ylmethyl)azepan-4-amine
CID 113487394
N-[(1-ethylpyrrolidin-2-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 64758375
2-[(1-ethylazepan-4-yl)amino]ethanol
CID 65074439
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-ethylpiperidin-4-amine
CID 63896493
N-[(1-hexylpyrrolidin-2-yl)methyl]cyclopropanamine
CID 62581263
N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]cyclopentanamine
CID 103852150

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine (CID 43179038) is 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine is CCN1CCC(NCC2CCCN2CC)CC1.
What is the InChIKey of 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine?
The InChIKey is AGDCYDRBNLMGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-3-16-10-7-13(8-11-16)15-12-14-6-5-9-17(14)4-2/h13-15H,3-12H2,1-2H3.
What are the key properties of 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine?
1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1-ethylpyrrolidin-2-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 43179038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).