N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine

C13H24N2 — CID 89299185

IUPACN-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine
SMILESC=C(CN1CCCCC1)NCC1CCC1
InChIInChI=1S/C13H24N2/c1-12(14-10-13-6-5-7-13)11-15-8-3-2-4-9-15/h13-14H,1-11H2
InChIKeyBLFJEKFRPQZSNK-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.38
Rot. Bonds5

About N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine

N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine (PubChem CID 89299185) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine
PubChem CID89299185
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC NameN-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine
SMILESC=C(CN1CCCCC1)NCC1CCC1
InChIInChI=1S/C13H24N2/c1-12(14-10-13-6-5-7-13)11-15-8-3-2-4-9-15/h13-14H,1-11H2
InChIKeyBLFJEKFRPQZSNK-UHFFFAOYSA-N
XLogP2.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methylidene-1-(2-methylpropyl)piperazine
CID 58326873
2-Piperidin-1-ylprop-2-en-1-amine
CID 69434721
3-Piperidin-1-ylprop-1-en-2-amine
CID 89021296
(3S)-N,4-dimethyl-2-(2-methylpiperidin-1-yl)pent-1-en-3-amine
CID 89058642
4-Methyl-1-prop-1-en-2-ylpiperidin-3-amine
CID 123215738
[1-(3-Azidoprop-1-en-2-yl)piperidin-4-yl]methanamine
CID 126633038
N-methyl-3-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]prop-1-en-2-amine
CID 135167698
N-methyl-3-[4-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]prop-1-en-2-amine
CID 135167819
2-(3-methylpiperidin-1-yl)-N-prop-1-en-2-ylpent-1-en-3-amine
CID 138744665
N-(2-piperidin-1-ylethyl)prop-1-en-2-amine
CID 142113057
N-[(1-methylpiperidin-4-yl)methyl]prop-1-en-2-amine
CID 143717182
(2S)-1-buta-1,3-dien-2-yl-2-(2-methylpropyl)piperazine
CID 144855512

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine?
The IUPAC name of N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine (CID 89299185) is N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine?
The canonical SMILES for N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine is C=C(CN1CCCCC1)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine?
The InChIKey is BLFJEKFRPQZSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-12(14-10-13-6-5-7-13)11-15-8-3-2-4-9-15/h13-14H,1-11H2.
What are the key properties of N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine?
N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine has a molecular weight of 208.35 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-3-piperidin-1-ylprop-1-en-2-amine is sourced from PubChem (CID 89299185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).