(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine

C16H24N2 — CID 21036983

IUPAC(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine
SMILESNCC1(C2CC2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C16H24N2/c17-13-16(15-6-7-15)8-10-18(11-9-16)12-14-4-2-1-3-5-14/h1-5,15H,6-13,17H2
InChIKeyWISVVOCMQVKZNZ-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.64
Rot. Bonds4

About (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine

(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine (PubChem CID 21036983) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine.

Molecular Properties

Compound Name(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine
PubChem CID21036983
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine
SMILESNCC1(C2CC2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C16H24N2/c17-13-16(15-6-7-15)8-10-18(11-9-16)12-14-4-2-1-3-5-14/h1-5,15H,6-13,17H2
InChIKeyWISVVOCMQVKZNZ-UHFFFAOYSA-N
XLogP2.64
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-benzyl-3-cyclopentylpyrrolidin-3-yl)methanamine
CID 83825709
(1-benzyl-4-cyclopropylpiperidin-4-yl)methyl carbamate
CID 175201473
[(1R,5R)-3-benzyl-3-azabicyclo[3.2.0]heptan-1-yl]methanamine
CID 129498513
(3-benzyl-3-azabicyclo[3.2.0]heptan-1-yl)methanamine
CID 121205300
4-(aminomethyl)-1-benzylpiperidin-4-ol;hydrochloride
CID 122236517
(1-benzyl-4-phenylpiperidin-4-yl)methanamine;hydrochloride
CID 170875383
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
(9-benzyl-1,5-dioxa-9-azaspiro[5.5]undecan-3-yl)methanamine
CID 82667511
(1-benzyl-4-methylsulfonylpiperidin-4-yl)methanamine
CID 99997092
1-(1-benzylazepan-4-yl)cyclopropan-1-amine
CID 83912862
1-benzyl-N,N-dicyclopropylpiperidin-4-amine
CID 11097616
9-benzyl-1,5-dioxa-9-azaspiro[5.5]undecan-3-amine
CID 82666438

Frequently Asked Questions

What is the IUPAC name of (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine?
The IUPAC name of (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine (CID 21036983) is (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine.
What is the SMILES notation for (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine?
The canonical SMILES for (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine is NCC1(C2CC2)CCN(Cc2ccccc2)CC1.
What is the InChIKey of (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine?
The InChIKey is WISVVOCMQVKZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c17-13-16(15-6-7-15)8-10-18(11-9-16)12-14-4-2-1-3-5-14/h1-5,15H,6-13,17H2.
What are the key properties of (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine?
(1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine has a molecular weight of 244.38 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyl-4-cyclopropylpiperidin-4-yl)methanamine is sourced from PubChem (CID 21036983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).