N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine

C17H27N3 — CID 64522855

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCC(C)CNCc1ccc(N(CC2CC2)C2CC2)nc1
InChIInChI=1S/C17H27N3/c1-13(2)9-18-10-15-5-8-17(19-11-15)20(16-6-7-16)12-14-3-4-14/h5,8,11,13-14,16,18H,3-4,6-7,9-10,12H2,1-2H3
InChIKeyTZXHOJSTQXNEBS-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.21
Rot. Bonds8

About N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine

N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 64522855) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID64522855
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCC(C)CNCc1ccc(N(CC2CC2)C2CC2)nc1
InChIInChI=1S/C17H27N3/c1-13(2)9-18-10-15-5-8-17(19-11-15)20(16-6-7-16)12-14-3-4-14/h5,8,11,13-14,16,18H,3-4,6-7,9-10,12H2,1-2H3
InChIKeyTZXHOJSTQXNEBS-UHFFFAOYSA-N
XLogP3.21
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 64522855) is N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine is CC(C)CNCc1ccc(N(CC2CC2)C2CC2)nc1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is TZXHOJSTQXNEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-13(2)9-18-10-15-5-8-17(19-11-15)20(16-6-7-16)12-14-3-4-14/h5,8,11,13-14,16,18H,3-4,6-7,9-10,12H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 273.42 g/mol, XLogP of 3.21, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 64522855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).