N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine

C12H24N2 — CID 91213184

IUPACN-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine
SMILESCCCN(CC1CC1)CN1CCCC1
InChIInChI=1S/C12H24N2/c1-2-7-14(10-12-5-6-12)11-13-8-3-4-9-13/h12H,2-11H2,1H3
InChIKeyONGRWUAYMSMUHK-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.16
Rot. Bonds6

About N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine

N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine (PubChem CID 91213184) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine
PubChem CID91213184
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine
SMILESCCCN(CC1CC1)CN1CCCC1
InChIInChI=1S/C12H24N2/c1-2-7-14(10-12-5-6-12)11-13-8-3-4-9-13/h12H,2-11H2,1H3
InChIKeyONGRWUAYMSMUHK-UHFFFAOYSA-N
XLogP2.16
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-ethylpiperidin-4-yl)methyl]-N-propylpropan-1-amine
CID 170705762
N-(2-bromoethyl)-N-(cyclopropylmethyl)propan-1-amine
CID 61445615
N-(cyclopropylmethyl)-N-propylbutan-1-amine
CID 89097130
N-(cyclopropylmethyl)-N-propylpentan-1-amine
CID 89142496
N-(cyclopropylmethyl)-3-methyl-N-propylbutan-1-amine
CID 21355618
N-(cyclopropylmethyl)-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]propan-1-amine
CID 75400617
2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
CID 62609054
(2R)-1-[cyclopropylmethyl(propyl)amino]propan-2-ol
CID 103935017
1-[2-[cyclopropylmethyl(propyl)amino]acetyl]piperidine-4-carboxylic acid
CID 62656849
1-[[cyclopropylmethyl(propyl)amino]methyl]cyclohexan-1-amine
CID 61443301
N-(cyclopropylmethyl)-N-propylpyrrolidine-1-carboxamide
CID 115578768
N-(cyclopentylmethyl)-N'-(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 55089985

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine (CID 91213184) is N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine is CCCN(CC1CC1)CN1CCCC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine?
The InChIKey is ONGRWUAYMSMUHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-2-7-14(10-12-5-6-12)11-13-8-3-4-9-13/h12H,2-11H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine?
N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.16, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-(pyrrolidin-1-ylmethyl)propan-1-amine is sourced from PubChem (CID 91213184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).