(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine

C10H22N2 — CID 103440582

IUPAC(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine
SMILESCC1CCN(C(C)C)C(CN)C1
InChIInChI=1S/C10H22N2/c1-8(2)12-5-4-9(3)6-10(12)7-11/h8-10H,4-7,11H2,1-3H3
InChIKeyKLOZMRSTHMGMNB-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.45
Rot. Bonds2

About (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine

(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine (PubChem CID 103440582) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine
PubChem CID103440582
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine
SMILESCC1CCN(C(C)C)C(CN)C1
InChIInChI=1S/C10H22N2/c1-8(2)12-5-4-9(3)6-10(12)7-11/h8-10H,4-7,11H2,1-3H3
InChIKeyKLOZMRSTHMGMNB-UHFFFAOYSA-N
XLogP1.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine?
The IUPAC name of (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine (CID 103440582) is (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine.
What is the SMILES notation for (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine?
The canonical SMILES for (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine is CC1CCN(C(C)C)C(CN)C1.
What is the InChIKey of (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine?
The InChIKey is KLOZMRSTHMGMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-8(2)12-5-4-9(3)6-10(12)7-11/h8-10H,4-7,11H2,1-3H3.
What are the key properties of (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine?
(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine has a molecular weight of 170.30 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine is sourced from PubChem (CID 103440582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).