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

C17H29N3 — CID 62283589

IUPACN-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCCCCN(c1ccc(CNCC(C)C)cn1)C1CC1
InChIInChI=1S/C17H29N3/c1-4-5-10-20(16-7-8-16)17-9-6-15(13-19-17)12-18-11-14(2)3/h6,9,13-14,16,18H,4-5,7-8,10-12H2,1-3H3
InChIKeyYRISTKZJCBPFID-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.60
Rot. Bonds9

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

N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 62283589) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID62283589
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCCCCN(c1ccc(CNCC(C)C)cn1)C1CC1
InChIInChI=1S/C17H29N3/c1-4-5-10-20(16-7-8-16)17-9-6-15(13-19-17)12-18-11-14(2)3/h6,9,13-14,16,18H,4-5,7-8,10-12H2,1-3H3
InChIKeyYRISTKZJCBPFID-UHFFFAOYSA-N
XLogP3.60
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62295141
N-butyl-N-cyclopropyl-5-(methylaminomethyl)pyridin-2-amine
CID 62283747
N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 64522855
2-[cyclopropyl-[5-(ethylaminomethyl)-2-pyridinyl]amino]ethanol
CID 80629638
3-[cyclobutyl-[5-(ethylaminomethyl)-2-pyridinyl]amino]propan-1-ol
CID 102864700
N-cyclopropyl-N-ethyl-5-(propylaminomethyl)pyridin-2-amine
CID 62279551
N-butyl-N-[[4-[(2-methylpropylamino)methyl]phenyl]methyl]cyclopropanamine
CID 62429494
N-cyclopropyl-N-ethyl-5-[(2-methylpropylamino)methyl]pyrimidin-2-amine
CID 113388029
N,N-dimethyl-N'-[5-[(2-methylpropylamino)methyl]-2-pyridinyl]-N'-propylethane-1,2-diamine
CID 62292737
5-(aminomethyl)-N-cyclopropyl-N-propylpyridin-2-amine
CID 43269938
N-cyclopropyl-N-ethyl-5-(methylaminomethyl)pyridin-2-amine
CID 62279376
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyridin-2-amine
CID 82960066

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 62283589) is N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine is CCCCN(c1ccc(CNCC(C)C)cn1)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is YRISTKZJCBPFID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-5-10-20(16-7-8-16)17-9-6-15(13-19-17)12-18-11-14(2)3/h6,9,13-14,16,18H,4-5,7-8,10-12H2,1-3H3.
What are the key properties of N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 275.44 g/mol, XLogP of 3.60, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62283589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).