N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine

C17H28N4 — CID 43478462

IUPACN-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
SMILESCCN(CC(C)C)c1nc2ccccn2c1CNC(C)C
InChIInChI=1S/C17H28N4/c1-6-20(12-13(2)3)17-15(11-18-14(4)5)21-10-8-7-9-16(21)19-17/h7-10,13-14,18H,6,11-12H2,1-5H3
InChIKeyOBAYSWCKCIBWCV-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.31
Rot. Bonds7

About N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine

N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine (PubChem CID 43478462) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
PubChem CID43478462
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC NameN-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine
SMILESCCN(CC(C)C)c1nc2ccccn2c1CNC(C)C
InChIInChI=1S/C17H28N4/c1-6-20(12-13(2)3)17-15(11-18-14(4)5)21-10-8-7-9-16(21)19-17/h7-10,13-14,18H,6,11-12H2,1-5H3
InChIKeyOBAYSWCKCIBWCV-UHFFFAOYSA-N
XLogP3.31
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine (CID 43478462) is N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine is CCN(CC(C)C)c1nc2ccccn2c1CNC(C)C.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
The InChIKey is OBAYSWCKCIBWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c1-6-20(12-13(2)3)17-15(11-18-14(4)5)21-10-8-7-9-16(21)19-17/h7-10,13-14,18H,6,11-12H2,1-5H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine?
N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine has a molecular weight of 288.44 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 43478462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).