1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine

C12H24N2 — CID 115020867

IUPAC1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine
SMILESCC(CN1CCCCC1)CC1(N)CC1
InChIInChI=1S/C12H24N2/c1-11(9-12(13)5-6-12)10-14-7-3-2-4-8-14/h11H,2-10,13H2,1H3
InChIKeyORXHAWNCGZYMBS-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds4

About 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine

1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine (PubChem CID 115020867) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine
PubChem CID115020867
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine
SMILESCC(CN1CCCCC1)CC1(N)CC1
InChIInChI=1S/C12H24N2/c1-11(9-12(13)5-6-12)10-14-7-3-2-4-8-14/h11H,2-10,13H2,1H3
InChIKeyORXHAWNCGZYMBS-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(azetidin-1-yl)-2-methylpropyl]cyclopropan-1-amine
CID 115013516
1-(3-bromo-2-methylpropyl)piperidine;hydrobromide
CID 139026359
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
1-(2,4-dimethylpentyl)cyclopropan-1-amine
CID 83682066
1-(2-chloropropyl)pyrrolidine
CID 3020097
2-methyl-N-[1-(1-methylcyclopropyl)ethyl]-3-piperidin-1-ylpropan-1-amine
CID 54906710
2-N-(2-methyl-3-piperidin-1-ylpropyl)propane-1,2-diamine
CID 103389396
1-(azacyclododec-1-yl)propan-2-ol
CID 58868254
5-methyl-N-(1-piperidin-1-ylpropan-2-yl)hexan-2-amine
CID 43749079
2-methyl-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 55141477
azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
4-methyl-5-piperidin-1-ylpentanal
CID 142529558

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine?
The IUPAC name of 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine (CID 115020867) is 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine.
What is the SMILES notation for 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine?
The canonical SMILES for 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine is CC(CN1CCCCC1)CC1(N)CC1.
What is the InChIKey of 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine?
The InChIKey is ORXHAWNCGZYMBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11(9-12(13)5-6-12)10-14-7-3-2-4-8-14/h11H,2-10,13H2,1H3.
What are the key properties of 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine?
1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-piperidin-1-ylpropyl)cyclopropan-1-amine is sourced from PubChem (CID 115020867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).