1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine

C12H26N2 — CID 22958932

IUPAC1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine
SMILESCC(C)N(CC1(N(C)C)CC1)C(C)C
InChIInChI=1S/C12H26N2/c1-10(2)14(11(3)4)9-12(7-8-12)13(5)6/h10-11H,7-9H2,1-6H3
InChIKeyDIVZEEPSSXEKNS-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.20
Rot. Bonds5

About 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine

1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine (PubChem CID 22958932) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine.

Molecular Properties

Compound Name1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine
PubChem CID22958932
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine
SMILESCC(C)N(CC1(N(C)C)CC1)C(C)C
InChIInChI=1S/C12H26N2/c1-10(2)14(11(3)4)9-12(7-8-12)13(5)6/h10-11H,7-9H2,1-6H3
InChIKeyDIVZEEPSSXEKNS-UHFFFAOYSA-N
XLogP2.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine?
The IUPAC name of 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine (CID 22958932) is 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine.
What is the SMILES notation for 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine?
The canonical SMILES for 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine is CC(C)N(CC1(N(C)C)CC1)C(C)C.
What is the InChIKey of 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine?
The InChIKey is DIVZEEPSSXEKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-10(2)14(11(3)4)9-12(7-8-12)13(5)6/h10-11H,7-9H2,1-6H3.
What are the key properties of 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine?
1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine has a molecular weight of 198.35 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[di(propan-2-yl)amino]methyl]-N,N-dimethylcyclopropan-1-amine is sourced from PubChem (CID 22958932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).