N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine

C16H32N2 — CID 63133310

IUPACN-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine
SMILESCCCC1(CN(CC(C)C)C2CC2)CCCNC1
InChIInChI=1S/C16H32N2/c1-4-8-16(9-5-10-17-12-16)13-18(11-14(2)3)15-6-7-15/h14-15,17H,4-13H2,1-3H3
InChIKeyFEQMVHJSJYYQNJ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds7

About N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine

N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine (PubChem CID 63133310) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine
PubChem CID63133310
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine
SMILESCCCC1(CN(CC(C)C)C2CC2)CCCNC1
InChIInChI=1S/C16H32N2/c1-4-8-16(9-5-10-17-12-16)13-18(11-14(2)3)15-6-7-15/h14-15,17H,4-13H2,1-3H3
InChIKeyFEQMVHJSJYYQNJ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylpropyl)-N-[(3-propylpyrrolidin-3-yl)methyl]cyclopropanamine
CID 55166322
N-ethyl-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine
CID 63133418
N-ethyl-N-[(3-propylpyrrolidin-3-yl)methyl]cyclopropanamine
CID 63142730
3-methyl-N-(3-methylbutyl)-N-[(3-propylpiperidin-3-yl)methyl]butan-1-amine
CID 107870233
N-ethyl-N-[(3-ethylpiperidin-3-yl)methyl]cyclopropanamine
CID 63133416
[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62266509
N-(cyclopropylmethyl)-N-[(3-propylpyrrolidin-3-yl)methyl]cyclopropanamine
CID 64520378
N-methyl-N-[(3-propylpiperidin-3-yl)methyl]propan-1-amine
CID 63132958
N,2-dimethyl-N-[(3-propylpyrrolidin-3-yl)methyl]propan-1-amine
CID 63143069
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115448961
N-[[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 62260942
N-[(3-ethylpiperidin-3-yl)methyl]-N-(2-methoxyethyl)cyclopropanamine
CID 63132980

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine?
The IUPAC name of N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine (CID 63133310) is N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine?
The canonical SMILES for N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine is CCCC1(CN(CC(C)C)C2CC2)CCCNC1.
What is the InChIKey of N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine?
The InChIKey is FEQMVHJSJYYQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-8-16(9-5-10-17-12-16)13-18(11-14(2)3)15-6-7-15/h14-15,17H,4-13H2,1-3H3.
What are the key properties of N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine?
N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine is sourced from PubChem (CID 63133310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).