2,2-dimethyl-N,N-bis(methylamino)propan-1-amine

C7H19N3 — CID 19987657

IUPAC2,2-dimethyl-N,N-bis(methylamino)propan-1-amine
SMILESCNN(CC(C)(C)C)NC
InChIInChI=1S/C7H19N3/c1-7(2,3)6-10(8-4)9-5/h8-9H,6H2,1-5H3
InChIKeyFHFSRHQIVLFKEK-UHFFFAOYSA-N
MW145.25 g/mol
LogP0.60
Rot. Bonds3

About 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine

2,2-dimethyl-N,N-bis(methylamino)propan-1-amine (PubChem CID 19987657) has the molecular formula C7H19N3 and a molecular weight of 145.25 g/mol. Its IUPAC name is 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N,N-bis(methylamino)propan-1-amine
PubChem CID19987657
Molecular FormulaC7H19N3
Molecular Weight145.25 g/mol
Exact Mass145.16
IUPAC Name2,2-dimethyl-N,N-bis(methylamino)propan-1-amine
SMILESCNN(CC(C)(C)C)NC
InChIInChI=1S/C7H19N3/c1-7(2,3)6-10(8-4)9-5/h8-9H,6H2,1-5H3
InChIKeyFHFSRHQIVLFKEK-UHFFFAOYSA-N
XLogP0.60
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine?
The IUPAC name of 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine (CID 19987657) is 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine is CNN(CC(C)(C)C)NC.
What is the InChIKey of 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine?
The InChIKey is FHFSRHQIVLFKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3/c1-7(2,3)6-10(8-4)9-5/h8-9H,6H2,1-5H3.
What are the key properties of 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine?
2,2-dimethyl-N,N-bis(methylamino)propan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N,N-bis(methylamino)propan-1-amine is sourced from PubChem (CID 19987657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).